Geometry & MOs

Info

ID:	236860
PubChem CID:	92715125
Reduced:	N2O5H26C28 (1)
Stoich.:	A2B5C26D28 (1)
Weight, g/mol:	408.204907
ΔH_f, kcal/mol:	-147.07
Dipole, Da:	6.81
IP(EA), eV:	-8.68(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[4-(dimethylamino)anilino]-1-oxopropan-2-yl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoate

Drug info:

PubChemData

Smile

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)OCC(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations